Compound Identification
SMILES
CCC[C@](C)(CF)S(=O)[C@@](C)(CF)CCC
InChIKey
InChIKey=KXELLLYMOOEOFC-VXGBXAGGSA-N
Formula
C12H24F2OS
Mass
254.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
- Subclass Sulfur mustard compounds
-
Class
Thioethers
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioethers
Subclass
Sulfur mustard compounds
Intermediate Tree Nodes
Not available
Direct Parent
Sulfur mustard compounds
Alternative Parents
Sulfoxides Sulfinyl compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Sulfur mustard - Sulfoxide - Sulfinyl compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as sulfur mustard compounds. These are compounds containing having two beta-haloalkyl groups bound to a sulfur atom.
External Descriptors
Not available